Geometry & MOs

Info

ID:	305701
PubChem CID:	124966022
Reduced:	SO2N4C18H22 (1)
Stoich.:	AB2C4D18E22 (1)
Weight, g/mol:	358.146347
ΔH_f, kcal/mol:	-39.47
Dipole, Da:	6.15
IP(EA), eV:	-9.09(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-benzyl-4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)piperazine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C)C(=O)N2CCN([C@@H](C2)C(=O)N)CC3=CC=CC=C3

DOS

IR

Vibrations