Geometry & MOs

Info

ID:	64947
PubChem CID:	29204236
Reduced:	ON4H24C25 (1)
Stoich.:	AB4C24D25 (1)
Weight, g/mol:	446.162391
ΔH_f, kcal/mol:	61.41
Dipole, Da:	5.66
IP(EA), eV:	-8.99(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-morpholin-4-yl-5-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=C(C=C3)C)C(=O)NCC4=CN=CC=C4

DOS

IR

Vibrations