Geometry & MOs

Info

ID:	68360
PubChem CID:	46508257
Reduced:	SO2N4H22C23 (1)
Stoich.:	AB2C4D22E23 (1)
Weight, g/mol:	299.107005
ΔH_f, kcal/mol:	38.76
Dipole, Da:	6.96
IP(EA), eV:	-8.75(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]furan-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2C(=C(N(C(=S)N2)C3=CC=CC=C3)C)C(=O)NC4=NOC(=C4)C

DOS

IR

Vibrations