Geometry & MOs

Info

ID:	414791
PubChem CID:	135087754
Reduced:	O2N5C13H19 (1)
Stoich.:	A2B5C13D19 (1)
Weight, g/mol:	508.232185
ΔH_f, kcal/mol:	-43.97
Dipole, Da:	6.5
IP(EA), eV:	-8.86(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,7S)-13-methoxy-5-(piperidine-4-carbonyl)-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=CN=C(N=C1N(C)C)N2CCN3C(C2)COC3=O

DOS

IR

Vibrations