Geometry & MOs

Info

ID:	216576
PubChem CID:	85086445
Reduced:	OC9H17 (2)
Stoich.:	AB9C17 (2)
Weight, g/mol:	282.25588
ΔH_f, kcal/mol:	-156.34
Dipole, Da:	1.61
IP(EA), eV:	-9.57(2.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-butyldodec-7-enyl acetate

Drug info:

PubChemData

Smile

CC(CC(C)OC1CC2CCCCCCCC(C2)C1)O

DOS

IR

Vibrations