Geometry & MOs

Info

ID:	20602
PubChem CID:	584806
Reduced:	NOC21H27 (1)
Stoich.:	ABC21D27 (1)
Weight, g/mol:	309.209264
ΔH_f, kcal/mol:	-66.24
Dipole, Da:	4.51
IP(EA), eV:	-8.57(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6,7,8-tetrahydronaphthalen-1-yl)adamantane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=CC=C2NC(=O)C34CC5CC(C3)CC(C5)C4

DOS

IR

Vibrations