Geometry & MOs

Info

ID:	239171
PubChem CID:	93166083
Reduced:	NO3C21H27 (1)
Stoich.:	AB3C21D27 (1)
Weight, g/mol:	341.199094
ΔH_f, kcal/mol:	-66.61
Dipole, Da:	1.83
IP(EA), eV:	-8.77(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-[benzyl-[(2,3-dimethoxyphenyl)methyl]amino]-2-methylbut-3-en-2-ol

Drug info:

PubChemData

Smile

C[C@@](CN(CC1=CC=CC=C1)CC2=C(C(=CC=C2)OC)OC)(C=C)O

DOS

IR

Vibrations