Geometry & MOs

Info

ID:	149634
PubChem CID:	53789308
Reduced:	O3C20H34 (1)
Stoich.:	A3B20C34 (1)
Weight, g/mol:	172.109944
ΔH_f, kcal/mol:	-146.4
Dipole, Da:	3.17
IP(EA), eV:	-9.48(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methoxy-3-methylbutyl) prop-2-enoate

Drug info:

PubChemData

Smile

C1C=C[C@](C1CC=CCCCCO)(C=CCCCCCCO)O

DOS

IR

Vibrations