Geometry & MOs

Info

ID:	395812
PubChem CID:	135026634
Reduced:	OC19H20 (1)
Stoich.:	AB19C20 (1)
Weight, g/mol:	264.151415
ΔH_f, kcal/mol:	-13.07
Dipole, Da:	2.45
IP(EA), eV:	-8.74(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S)-2-benzyl-5,8-dimethyl-1,2-dihydronaphthalen-1-ol

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)[C@H]([C@H](C=C2)CC3=CC=CC=C3)O

DOS

IR

Vibrations