Geometry & MOs

Info

ID:	215848
PubChem CID:	85085341
Reduced:	OSN4C5H8 (1)
Stoich.:	ABC4D5E8 (1)
Weight, g/mol:	172.109944
ΔH_f, kcal/mol:	62.66
Dipole, Da:	5.17
IP(EA), eV:	-8.83(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethyl-1,3-dioxolan-4-yl)-2-methylprop-2-en-1-ol

Drug info:

PubChemData

Smile

CCC1=NN(C(=NN=O)S1)C

DOS

IR

Vibrations