Geometry & MOs

Info

ID:	279629
PubChem CID:	103844509
Reduced:	ClN2O2C14H17 (1)
Stoich.:	AB2C2D14E17 (1)
Weight, g/mol:	273.100108
ΔH_f, kcal/mol:	-40.2
Dipole, Da:	2.85
IP(EA), eV:	-8.82(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(3-nitrophenyl)methoxy]phenyl]ethanol

Drug info:

PubChemData

Smile

CC1=NN(C(=C1COC2=CC=C(C=C2)CCO)Cl)C

DOS

IR

Vibrations