Geometry & MOs

Info

ID:	243536
PubChem CID:	99226518
Reduced:	N3O4C29H29 (1)
Stoich.:	A3B4C29D29 (1)
Weight, g/mol:	460.160283
ΔH_f, kcal/mol:	-74.49
Dipole, Da:	4.82
IP(EA), eV:	-9.05(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-[2-(dimethylamino)ethyl]indole-3-carbonyl]piperidin-4-yl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)COC2=CC=C(C=C2)CNC(=O)CNC(=O)[C@@H]3C4=CC=CC=C4C(=O)N3C5CC5

DOS

IR

Vibrations