Geometry & MOs

Info

ID:	5223
PubChem CID:	12788
Reduced:	NO3C7H7 (1)
Stoich.:	AB3C7D7 (1)
Weight, g/mol:	153.042593
ΔH_f, kcal/mol:	-34.99
Dipole, Da:	7.62
IP(EA), eV:	-9.91(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-2-nitrophenol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)[N+](=O)[O-])O

DOS

IR

Vibrations