Geometry & MOs

Info

ID:	407835
PubChem CID:	135080590
Reduced:	BrClOC5H8 (1)
Stoich.:	ABCD5E8 (1)
Weight, g/mol:	204.162649
ΔH_f, kcal/mol:	-50.04
Dipole, Da:	1.81
IP(EA), eV:	-10.65(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-adamantylideneamino)prop-2-en-1-amine

Drug info:

PubChemData

Smile

C=C[C@](CO)(CBr)Cl

DOS

IR

Vibrations