Geometry & MOs

Info

ID:	58627
PubChem CID:	24712326
Reduced:	ClON4C18H23 (1)
Stoich.:	ABC4D18E23 (1)
Weight, g/mol:	313.15904
ΔH_f, kcal/mol:	3.07
Dipole, Da:	4.12
IP(EA), eV:	-9.19(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[(2-fluorophenyl)methyl]imidazol-2-yl]methyl]-N-prop-2-enylcyclopropanecarboxamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)N(CC=C)CC1=NC=CN1CC2=CC=CC=C2Cl

DOS

IR

Vibrations