Geometry & MOs

Info

ID:	204701
PubChem CID:	79999122
Reduced:	ClNOC16H22 (1)
Stoich.:	ABCD16E22 (1)
Weight, g/mol:	249.24565
ΔH_f, kcal/mol:	-64.58
Dipole, Da:	3.75
IP(EA), eV:	-9.64(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-N-(2-methylbutyl)adamantan-1-amine

Drug info:

PubChemData

Smile

CC12CC3CC(C1)(CC(C3)(C2)C4=C(N=CO4)CCl)C

DOS

IR

Vibrations