Geometry & MOs

Info

ID:	448452
PubChem CID:	135291038
Reduced:	O3C16H20 (1)
Stoich.:	A3B16C20 (1)
Weight, g/mol:	270.173213
ΔH_f, kcal/mol:	-123.91
Dipole, Da:	1.29
IP(EA), eV:	-9.68(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-nitrosophenyl)methyl]adamantan-2-amine

Drug info:

PubChemData

Smile

CC(=O)C1(CCCCC1)C(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations