Geometry & MOs

Info

ID:	79181
PubChem CID:	49747261
Reduced:	FO4N5C28H30 (1)
Stoich.:	AB4C5D28E30 (1)
Weight, g/mol:	473.127297
ΔH_f, kcal/mol:	-125.67
Dipole, Da:	1.78
IP(EA), eV:	-8.37(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dichloro-N-[2-(furan-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]benzamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2=CC=CC(=C2)NC(=O)C(=O)NCC(C3=CC=CO3)N4CCN(CC4)C5=CC=C(C=C5)F

DOS

IR

Vibrations