Geometry & MOs

Info

ID:	373076
PubChem CID:	131309483
Reduced:	SN2C8H8 (1)
Stoich.:	AB2C8D8 (1)
Weight, g/mol:	195.053158
ΔH_f, kcal/mol:	50.62
Dipole, Da:	2.78
IP(EA), eV:	-7.99(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-4-methyl-6-nitrobenzaldehyde

Drug info:

PubChemData

Smile

C1=CNC=C1C2=C(C=CS2)N

DOS

IR

Vibrations