Geometry & MOs

Info

ID:	269458
PubChem CID:	103617544
Reduced:	INO2C16H16 (1)
Stoich.:	ABC2D16E16 (1)
Weight, g/mol:	389.0288
ΔH_f, kcal/mol:	-26.38
Dipole, Da:	3.56
IP(EA), eV:	-8.8(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-4-fluoro-2-iodo-N-(oxolan-3-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)NC2=CC=CC=C2COC)I

DOS

IR

Vibrations