Geometry & MOs

Info

ID:	20606
PubChem CID:	584819
Reduced:	NOC20H27 (1)
Stoich.:	ABC20D27 (1)
Weight, g/mol:	297.209264
ΔH_f, kcal/mol:	-67.64
Dipole, Da:	3.63
IP(EA), eV:	-8.5(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-propan-2-ylphenyl)adamantane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations