Geometry & MOs

Info

ID:	32333
PubChem CID:	6436555
Reduced:	N2O3C25H48 (1)
Stoich.:	A2B3C25D48 (1)
Weight, g/mol:	152.120115
ΔH_f, kcal/mol:	-181.32
Dipole, Da:	11.32
IP(EA), eV:	-9.58(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-7-methyl-3-methylideneocta-4,6-dien-2-ol

Drug info:

PubChemData

Smile

CCCCCCCC/C=C\CCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)[O-]

DOS

IR

Vibrations