Geometry & MOs

Info

ID:	157993
PubChem CID:	56459382
Reduced:	O3N4C25H34 (1)
Stoich.:	A3B4C25D34 (1)
Weight, g/mol:	408.111981
ΔH_f, kcal/mol:	-80.71
Dipole, Da:	5.78
IP(EA), eV:	-8.78(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(3,5-dichloropyridin-2-yl)amino]ethyl]-3-(morpholin-4-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)C3CC4=CC=CC=C4CN3C(=O)CC(C)C

DOS

IR

Vibrations