Geometry & MOs

Info

ID:	215813
PubChem CID:	85085289
Reduced:	NO3C7H11 (1)
Stoich.:	AB3C7D11 (1)
Weight, g/mol:	158.094294
ΔH_f, kcal/mol:	-93.53
Dipole, Da:	1.84
IP(EA), eV:	-10.16(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-propoxybut-2-enoate

Drug info:

PubChemData

Smile

CC(=O)OC1CC(C=C1)ON

DOS

IR

Vibrations