Geometry & MOs

Info

ID:	4183
PubChem CID:	10931
Reduced:	O2C5H8 (1)
Stoich.:	A2B5C8 (1)
Weight, g/mol:	100.052429
ΔH_f, kcal/mol:	-91.5
Dipole, Da:	6.38
IP(EA), eV:	-10.64(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methylbut-2-enoic acid

Drug info:

PubChemData

Smile

CC(=CC(=O)O)C

DOS

IR

Vibrations