Geometry & MOs

Info

ID:

128660

PubChem CID:

51053639

Reduced:

SO2N5H21C22 (1)

Stoich.:

AB2C5D21E22 (1)

Weight, g/mol:

374.147786

ΔHf, kcal/mol:

59.88

Dipole, Da:

6.0

IP(EA), eV:

-8.79(-1.19)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-(3-methoxyphenyl)-2-[6-(morpholin-4-ylmethyl)-4-oxopyran-3-yl]oxyacetamide

Drug info:

PubChemData

Smile

CC(C)(C)N1C2=NC(=O)CSC(C2=CN1)C3=CC=C(C=C3)OC4=C(C=CC=N4)C#N

DOS

IR

Vibrations