Geometry & MOs

Info

ID:	351781
PubChem CID:	127282181
Reduced:	O2N5C17H27 (1)
Stoich.:	A2B5C17D27 (1)
Weight, g/mol:	335.206973
ΔH_f, kcal/mol:	-61.74
Dipole, Da:	2.68
IP(EA), eV:	-8.89(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-[2-(tetrazol-1-yl)acetyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)C3=CN(N=C3)C

DOS

IR

Vibrations