Geometry & MOs

Info

ID:	402383
PubChem CID:	135055782
Reduced:	N2O5H20C21 (1)
Stoich.:	A2B5C20D21 (1)
Weight, g/mol:	309.136493
ΔH_f, kcal/mol:	-141.88
Dipole, Da:	3.01
IP(EA), eV:	-9.09(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3R)-3-(1H-indol-3-yl)-3-(4-methoxyphenyl)propanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)/N=C(/C1=CC=C(C=C1)OC)\N2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations