Geometry & MOs

Info

ID:	70764
PubChem CID:	48413837
Reduced:	SN4O5C16H20 (1)
Stoich.:	AB4C5D16E20 (1)
Weight, g/mol:	336.158626
ΔH_f, kcal/mol:	-140.84
Dipole, Da:	7.59
IP(EA), eV:	-9.2(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(5-methyl-1H-pyrazol-4-yl)methylamino]-2-oxoethyl]-2-naphthalen-1-ylacetamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)CN(C)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations