Geometry & MOs

Info

ID:	372012
PubChem CID:	131286315
Reduced:	ON2C8H8 (1)
Stoich.:	AB2C8D8 (1)
Weight, g/mol:	142.135765
ΔH_f, kcal/mol:	25.18
Dipole, Da:	2.3
IP(EA), eV:	-9.9(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4,5-dimethylhept-3-en-2-ol

Drug info:

PubChemData

Smile

CC1=NC=CN=C1/C=C/C=O

DOS

IR

Vibrations