Geometry & MOs

Info

ID:	6626
PubChem CID:	69275
Reduced:	NO3C7H7 (1)
Stoich.:	AB3C7D7 (1)
Weight, g/mol:	153.042593
ΔH_f, kcal/mol:	-29.66
Dipole, Da:	4.79
IP(EA), eV:	-10.6(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-nitrophenyl)methanol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CO)[N+](=O)[O-]

DOS

IR

Vibrations