Geometry & MOs

Info

ID:	12350
PubChem CID:	135735
Reduced:	ClO2C17H31 (1)
Stoich.:	AB2C17D31 (1)
Weight, g/mol:	302.201258
ΔH_f, kcal/mol:	-167.9
Dipole, Da:	4.28
IP(EA), eV:	-10.28(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 11-chloro-3,7,11-trimethyldodec-2-enoate

Drug info:

PubChemData

Smile

CCOC(=O)C=C(C)CCCC(C)CCCC(C)(C)Cl

DOS

IR

Vibrations