Geometry & MOs

Info

ID:	280002
PubChem CID:	103846274
Reduced:	N4C9H10 (1)
Stoich.:	A4B9C10 (1)
Weight, g/mol:	218.105528
ΔH_f, kcal/mol:	76.56
Dipole, Da:	7.3
IP(EA), eV:	-8.45(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-amino-3-(1H-indol-5-yl)propanoate

Drug info:

PubChemData

Smile

CN1C=CN=C1NC2=CN=CC=C2

DOS

IR

Vibrations