Geometry & MOs

Info

ID:

417112

PubChem CID:

135091392

Reduced:

O3N5C17H21 (1)

Stoich.:

A3B5C17D21 (1)

Weight, g/mol:

573.202362

ΔHf, kcal/mol:

-83.14

Dipole, Da:

7.43

IP(EA), eV:

 -9.44(-0.49)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3S,7S)-5-(3-fluoro-6-methylimidazo[1,2-a]pyridine-2-carbonyl)-13-methoxy-2,15-dioxa-5,8,18-triazatetracyclo[18.2.2.110,14.03,7]pentacosa-1(23),10(25),11,13,20(24),21-hexaene-9,17-dione

Drug info:

PubChemData

Smile

CC1=C(C(=O)N=C(N1)C)CC(=O)N2C[C@H]([C@@H](C2)O)CC3=NC=CN=C3

DOS

IR

Vibrations