Geometry & MOs

Info

ID:	359756
PubChem CID:	127299703
Reduced:	SN4O4C17H26 (1)
Stoich.:	AB4C4D17E26 (1)
Weight, g/mol:	371.166748
ΔH_f, kcal/mol:	-159.95
Dipole, Da:	9.28
IP(EA), eV:	-9.82(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(2-thiophen-2-ylethyl)piperazine-1-carbonyl]-5,6,7,8-tetrahydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CNC(=O)C2CCCCC2C(=O)NC3CCS(=O)(=O)C3

DOS

IR

Vibrations