Geometry & MOs

Info

ID:	347691
PubChem CID:	127272571
Reduced:	O2N3C14H25 (1)
Stoich.:	A2B3C14D25 (1)
Weight, g/mol:	377.100954
ΔH_f, kcal/mol:	-111.28
Dipole, Da:	6.73
IP(EA), eV:	-8.95(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)CN2CCN(CC2)C(=O)C

DOS

IR

Vibrations