Geometry & MOs

Info

ID:	65743
PubChem CID:	46386816
Reduced:	ClOSN4H17C21 (1)
Stoich.:	ABCD4E17F21 (1)
Weight, g/mol:	358.083268
ΔH_f, kcal/mol:	50.42
Dipole, Da:	3.75
IP(EA), eV:	-8.77(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(5-chloro-2-pyridin-4-yl-1H-indol-3-yl)carbamoylamino]acetate

Drug info:

PubChemData

Smile

CSC1=CC=CC(=C1)NC(=O)NC2=C(NC3=C2C=C(C=C3)Cl)C4=CC=NC=C4

DOS

IR

Vibrations