Geometry & MOs

Info

ID:	277870
PubChem CID:	103831404
Reduced:	NOC8H13 (2)
Stoich.:	ABC8D13 (2)
Weight, g/mol:	198.173213
ΔH_f, kcal/mol:	-96.99
Dipole, Da:	3.94
IP(EA), eV:	-8.85(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[(2-methylcyclopropyl)methyl]hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NC(C)CC1=CC=CC=C1OC)N

DOS

IR

Vibrations