Geometry & MOs

Info

ID:	122690
PubChem CID:	50817370
Reduced:	FN3O3C20H22 (1)
Stoich.:	AB3C3D20E22 (1)
Weight, g/mol:	371.16452
ΔH_f, kcal/mol:	-112.13
Dipole, Da:	0.69
IP(EA), eV:	-8.7(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)NC(=NCC2CCCO2)NC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations