Geometry & MOs

Info

ID:	359236
PubChem CID:	127297733
Reduced:	O2N7C19H33 (1)
Stoich.:	A2B7C19D33 (1)
Weight, g/mol:	393.219846
ΔH_f, kcal/mol:	-71.5
Dipole, Da:	3.7
IP(EA), eV:	-9.07(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[(3-methylcyclohexyl)amino]-2-oxoethyl]-N-[(4-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCC(C1)NC(=O)CN2CCN(CC2)C(=O)NC(C)CN3C=NC=N3

DOS

IR

Vibrations