Geometry & MOs

Info

ID:	351310
PubChem CID:	127280198
Reduced:	O4N5C19H31 (1)
Stoich.:	A4B5C19D31 (1)
Weight, g/mol:	349.222623
ΔH_f, kcal/mol:	-179.04
Dipole, Da:	4.66
IP(EA), eV:	-8.85(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-methyl-2-[4-[2-(tetrazol-1-yl)acetyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CN1CC(=O)N(C1=O)CC(=O)N2CCN(CC2)CC(=O)N(C)C3CCCCC3

DOS

IR

Vibrations