Geometry & MOs

Info

ID:	45748
PubChem CID:	10517266
Reduced:	NO2C18H23 (1)
Stoich.:	AB2C18D23 (1)
Weight, g/mol:	285.220292
ΔH_f, kcal/mol:	-49.52
Dipole, Da:	3.13
IP(EA), eV:	-8.96(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,4aS)-10-deuterio-1,4a-dimethyl-7-propan-2-yl-2,3,4,10a-tetrahydrophenanthren-1-yl]methanol

Drug info:

PubChemData

Smile

CN(CC[C@@H](C1=CC=CC=C1)O)C[C@H](C2=CC=CC=C2)O

DOS

IR

Vibrations