Geometry & MOs

Info

ID:	125949
PubChem CID:	50945145
Reduced:	FON7C18H20 (1)
Stoich.:	ABC7D18E20 (1)
Weight, g/mol:	322.116486
ΔH_f, kcal/mol:	3.99
Dipole, Da:	3.93
IP(EA), eV:	-9.06(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5,6,7-trimethoxy-1H-indole-2-carbonyl)amino]propanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=NC=NC(=C2)NCCNC(=O)NC3=CC=C(C=C3)F)C

DOS

IR

Vibrations