Geometry & MOs

Info

ID:	394670
PubChem CID:	135023483
Reduced:	N2O4H22C25 (1)
Stoich.:	A2B4C22D25 (1)
Weight, g/mol:	128.08373
ΔH_f, kcal/mol:	-40.97
Dipole, Da:	6.62
IP(EA), eV:	-8.97(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(oxolan-2-yl)prop-2-en-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1O)C=O)C2N=C(C(=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

DOS

IR

Vibrations