Geometry & MOs

Info

ID:	64950
PubChem CID:	29204242
Reduced:	SO3N4C18H18 (1)
Stoich.:	AB3C4D18E18 (1)
Weight, g/mol:	300.147393
ΔH_f, kcal/mol:	-31.23
Dipole, Da:	10.95
IP(EA), eV:	-9.63(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-diethoxy-N-(pyridin-3-ylmethyl)benzamide

Drug info:

PubChemData

Smile

C1C[C@H](N(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NCC4=CN=CC=C4

DOS

IR

Vibrations