Geometry & MOs

Info

ID:	122689
PubChem CID:	50817369
Reduced:	N3O4C22H27 (1)
Stoich.:	A3B4C22D27 (1)
Weight, g/mol:	371.16452
ΔH_f, kcal/mol:	-108.28
Dipole, Da:	4.28
IP(EA), eV:	-8.66(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-[N-(3-methoxyphenyl)-N'-(oxolan-2-ylmethyl)carbamimidoyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=NCC2CCCO2)NC(=O)C3=CC(=CC(=C3)OC)OC

DOS

IR

Vibrations