Geometry & MOs

Info

ID:	65468
PubChem CID:	38671763
Reduced:	O2N3C23H23 (1)
Stoich.:	A2B3C23D23 (1)
Weight, g/mol:	418.079884
ΔH_f, kcal/mol:	17.82
Dipole, Da:	3.95
IP(EA), eV:	-8.97(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(difluoromethylsulfonyl)-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide

Drug info:

PubChemData

Smile

CCN(CC1=CC=CO1)C(=O)CN2C3=CC=CC=C3N=C2CC4=CC=CC=C4

DOS

IR

Vibrations