Geometry & MOs

Info

ID:	182500
PubChem CID:	76894905
Reduced:	NOC5H7 (3)
Stoich.:	ABC5D7 (3)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-101.49
Dipole, Da:	2.73
IP(EA), eV:	-8.66(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[2-amino-3-(1H-indol-3-yl)propanoyl]-methylamino]acetate

Drug info:

PubChemData

Smile

CN(CC(=O)NCCOC)C(=O)C1CC2=CC=CC=C2N1

DOS

IR

Vibrations