Geometry & MOs

Info

ID:	414157
PubChem CID:	135087112
Reduced:	NO2C9H13 (2)
Stoich.:	AB2C9D13 (2)
Weight, g/mol:	334.189257
ΔH_f, kcal/mol:	-155.96
Dipole, Da:	6.28
IP(EA), eV:	-8.46(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3,3-diethoxy-2-(1H-indol-2-ylmethylamino)butanoate

Drug info:

PubChemData

Smile

CCC(C(C(=O)O)NCC1=CC2=CC=CC=C2N1)(OCC)OCC

DOS

IR

Vibrations