Geometry & MOs

Info

ID:	48796
PubChem CID:	11528340
Reduced:	NOC2H5 (2)
Stoich.:	ABC2D5 (2)
Weight, g/mol:	120.0939
ΔH_f, kcal/mol:	-105.99
Dipole, Da:	3.55
IP(EA), eV:	-9.93(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6,7,7a-tetrahydro-1H-indene

Drug info:

PubChemData

Smile

CC(CNC(=O)N)O

DOS

IR

Vibrations