Geometry & MOs

Info

ID:	415308
PubChem CID:	135088302
Reduced:	O3N4C19H24 (1)
Stoich.:	A3B4C19D24 (1)
Weight, g/mol:	351.125277
ΔH_f, kcal/mol:	-102.73
Dipole, Da:	8.99
IP(EA), eV:	-9.35(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC(=O)N1)C)CCC(=O)N2C[C@H]([C@@H](C2)O)CC3=CC=CC=N3

DOS

IR

Vibrations