Geometry & MOs

Info

ID:	214157
PubChem CID:	81087109
Reduced:	ON3C12H25 (1)
Stoich.:	AB3C12D25 (1)
Weight, g/mol:	223.168462
ΔH_f, kcal/mol:	-76.43
Dipole, Da:	3.55
IP(EA), eV:	-8.79(1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(aminomethyl)-N-(2-cyanoethyl)-N-cyclopropylpentanamide

Drug info:

PubChemData

Smile

CCN1CCC(CC1)NC(=O)CC(C)CN

DOS

IR

Vibrations