Geometry & MOs

Info

ID:	354702
PubChem CID:	127287401
Reduced:	ON5C21H25 (1)
Stoich.:	AB5C21D25 (1)
Weight, g/mol:	251.199762
ΔH_f, kcal/mol:	23.16
Dipole, Da:	4.09
IP(EA), eV:	-9.12(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopropyl-N-(2-methylcyclopentyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCC1NC(=O)N2CCN(CC2)C3=C(C=NC4=CC=CC=C43)C#N

DOS

IR

Vibrations