Geometry & MOs

Info

ID:	348265
PubChem CID:	127273330
Reduced:	N4O4C17H30 (1)
Stoich.:	A4B4C17D30 (1)
Weight, g/mol:	393.071404
ΔH_f, kcal/mol:	-165.89
Dipole, Da:	5.31
IP(EA), eV:	-9.04(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloro-2-fluorophenyl)-[4-(2-cyclopropyl-1,3-thiazole-4-carbonyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CN(CCN(C1)CC(=O)N2CCOCC2)CC(=O)N3CCOCC3

DOS

IR

Vibrations