Geometry & MOs

Info

ID:	51469
PubChem CID:	12014145
Reduced:	NOH9C11 (1)
Stoich.:	ABC9D11 (1)
Weight, g/mol:	171.068414
ΔH_f, kcal/mol:	8.01
Dipole, Da:	2.84
IP(EA), eV:	-9.24(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-isocyanato-1,2-dihydronaphthalene

Drug info:

PubChemData

Smile

C1C=C(CC2=CC=CC=C21)N=C=O

DOS

IR

Vibrations