Geometry & MOs

Info

ID:	239153
PubChem CID:	93166062
Reduced:	NO3C17H29 (1)
Stoich.:	AB3C17D29 (1)
Weight, g/mol:	321.230394
ΔH_f, kcal/mol:	-132.59
Dipole, Da:	2.19
IP(EA), eV:	-8.21(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC[C@H](C)N(CC1=CC(=C(C=C1)OC)OC)CC(C)(C)O

DOS

IR

Vibrations