Geometry & MOs

Info

ID:	239149
PubChem CID:	93166057
Reduced:	NO4C17H27 (1)
Stoich.:	AB4C17D27 (1)
Weight, g/mol:	309.194008
ΔH_f, kcal/mol:	-129.91
Dipole, Da:	3.0
IP(EA), eV:	-8.32(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-[(3,4-dimethoxyphenyl)methyl-(2-methoxyethyl)amino]-2-methylbut-3-en-2-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations