Geometry & MOs

Info

ID:	29210
PubChem CID:	832329
Reduced:	SO2N3H15C19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	308.116092
ΔH_f, kcal/mol:	30.88
Dipole, Da:	3.49
IP(EA), eV:	-9.08(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(2-anilino-2-oxoethyl)indole-3-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2C4=CN=CS4

DOS

IR

Vibrations