Geometry & MOs

Info

ID:	203579
PubChem CID:	79847362
Reduced:	NSC18H29 (1)
Stoich.:	ABC18D29 (1)
Weight, g/mol:	239.17461
ΔH_f, kcal/mol:	-23.59
Dipole, Da:	2.94
IP(EA), eV:	-8.07(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-azidoethylamino)-2,2-dimethylcyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CCNC1C(CCCC1(C)C)SCC2=CC=CC(=C2)C

DOS

IR

Vibrations