Geometry & MOs

Info

ID:	65772
PubChem CID:	46386852
Reduced:	ClFON4H16C21 (1)
Stoich.:	ABCD4E16F21 (1)
Weight, g/mol:	358.083268
ΔH_f, kcal/mol:	-0.92
Dipole, Da:	3.05
IP(EA), eV:	-8.83(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(7-chloro-2-pyridin-4-yl-1H-indol-3-yl)carbamoylamino]acetate

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)Cl)NC(=C2NC(=O)NCC3=CC=C(C=C3)F)C4=CC=NC=C4

DOS

IR

Vibrations