Geometry & MOs

Info

ID:	214134
PubChem CID:	81086994
Reduced:	NOC7H12 (2)
Stoich.:	ABC7D12 (2)
Weight, g/mol:	252.220164
ΔH_f, kcal/mol:	-91.79
Dipole, Da:	3.57
IP(EA), eV:	-8.91(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(cyclohexylmethyl)-N-cyclopropyl-3-methylbutanamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CN(C(C)C)C(=O)CC(C)CN

DOS

IR

Vibrations