Geometry & MOs

Info

ID:	232444
PubChem CID:	87576195
Reduced:	ClON4C16H21 (1)
Stoich.:	ABC4D16E21 (1)
Weight, g/mol:	484.214427
ΔH_f, kcal/mol:	-10.39
Dipole, Da:	4.14
IP(EA), eV:	-8.61(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-[3-(ethoxyamino)propylsulfonyl]piperidin-4-yl]-5-phenyl-1H-indole-7-carboxamide

Drug info:

PubChemData

Smile

CN1C2=CN=C(N=C2N(C3CCCC3C1=O)C4CCCC4)Cl

DOS

IR

Vibrations