Geometry & MOs

Info

ID:	333069
PubChem CID:	127251493
Reduced:	O3N5C25H31 (1)
Stoich.:	A3B5C25D31 (1)
Weight, g/mol:	381.205242
ΔH_f, kcal/mol:	-54.8
Dipole, Da:	3.4
IP(EA), eV:	-8.93(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-[6-methyl-4-[(4-methylphenyl)methyl]pyridin-2-yl]morpholin-4-yl]-2-oxoethyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)C2CN(CCO2)C(=O)CCN3C(=NC(=N3)C)C)CC4=CC(=CC=C4)OC

DOS

IR

Vibrations