Geometry & MOs

Info

ID:	149217
PubChem CID:	53788889
Reduced:	NO4C13H17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	228.172545
ΔH_f, kcal/mol:	-158.96
Dipole, Da:	5.2
IP(EA), eV:	-9.66(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 7-methoxy-3,7-dimethylnon-2-enoate

Drug info:

PubChemData

Smile

CCOC(C(=O)O)N(CC1=CC=CC=C1)C(=O)C

DOS

IR

Vibrations