Geometry & MOs

Info

ID:	398498
PubChem CID:	135033519
Reduced:	NO2C18H19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	190.135765
ΔH_f, kcal/mol:	-44.93
Dipole, Da:	3.41
IP(EA), eV:	-8.99(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-phenylhex-5-en-2-ol

Drug info:

PubChemData

Smile

CC(C)(C)O[C@@]1(C2=CC=CC=C2NC1=O)C3=CC=CC=C3

DOS

IR

Vibrations