Geometry & MOs

Info

ID:	122720
PubChem CID:	50818562
Reduced:	OF2N4H18C21 (1)
Stoich.:	AB2C4D18E21 (1)
Weight, g/mol:	362.154289
ΔH_f, kcal/mol:	-36.05
Dipole, Da:	2.02
IP(EA), eV:	-8.86(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-[N-(3-methylphenyl)-N'-(pyridin-3-ylmethyl)carbamimidoyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=NCC2=CN=CC=C2)NC(=O)C3=CC(=C(C=C3)F)F

DOS

IR

Vibrations