Geometry & MOs

Info

ID:	4463
PubChem CID:	11443
Reduced:	N2O2H6C9 (1)
Stoich.:	A2B2C6D9 (1)
Weight, g/mol:	174.042927
ΔH_f, kcal/mol:	-21.52
Dipole, Da:	2.79
IP(EA), eV:	-9.21(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-diisocyanato-1-methylbenzene

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N=C=O)N=C=O

DOS

IR

Vibrations