Geometry & MOs

Info

ID:	70849
PubChem CID:	48413949
Reduced:	SN4O5C16H22 (1)
Stoich.:	AB4C5D16E22 (1)
Weight, g/mol:	339.169525
ΔH_f, kcal/mol:	-150.36
Dipole, Da:	6.63
IP(EA), eV:	-8.97(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-3-(1H-indol-3-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)CCNS(=O)(=O)C2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations