Geometry & MOs

Info

ID:	149085
PubChem CID:	53788756
Reduced:	INO2H8C10 (1)
Stoich.:	ABC2D8E10 (1)
Weight, g/mol:	282.234751
ΔH_f, kcal/mol:	9.06
Dipole, Da:	2.48
IP(EA), eV:	-9.45(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-phenylpentyl)adamantane

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CC#CI)OC(=O)N

DOS

IR

Vibrations