Geometry & MOs

Info

ID:	279492
PubChem CID:	103844113
Reduced:	NO2C7H7 (2)
Stoich.:	AB2C7D7 (2)
Weight, g/mol:	274.095357
ΔH_f, kcal/mol:	-47.42
Dipole, Da:	4.53
IP(EA), eV:	-9.7(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-methyl-3-nitropyridin-2-yl)oxyphenyl]ethanol

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)OC2=CC=C(C=C2)CCO)[N+](=O)[O-]

DOS

IR

Vibrations