Geometry & MOs

Info

ID:	64931
PubChem CID:	29204213
Reduced:	SN4O4C21H28 (1)
Stoich.:	AB4C4D21E28 (1)
Weight, g/mol:	270.111676
ΔH_f, kcal/mol:	-114.61
Dipole, Da:	3.59
IP(EA), eV:	-9.32(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(carbamoylamino)-N-(pyridin-3-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)C(=O)NCC3=CN=CC=C3

DOS

IR

Vibrations