Geometry & MOs

Info

ID:	199157
PubChem CID:	79208159
Reduced:	N2O2C5H7 (2)
Stoich.:	A2B2C5D7 (2)
Weight, g/mol:	224.188863
ΔH_f, kcal/mol:	-120.73
Dipole, Da:	4.14
IP(EA), eV:	-9.45(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(3-ethylpentan-2-yl)cyclopent-2-ene-1-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=NN=C(C=C1)NC(CO)C(=O)OC

DOS

IR

Vibrations