Geometry & MOs

Info

ID:	70390
PubChem CID:	48413281
Reduced:	SN4O4C19H28 (1)
Stoich.:	AB4C4D19E28 (1)
Weight, g/mol:	415.156577
ΔH_f, kcal/mol:	-103.76
Dipole, Da:	6.5
IP(EA), eV:	-8.27(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,5-dimethoxyphenyl)methyl]-N-(1-methylpyrazol-4-yl)-2-phenylethanesulfonamide

Drug info:

PubChemData

Smile

CC1CCCCN1S(=O)(=O)N(CC2=C(C=CC(=C2)OC)OC)C3=CN(N=C3)C

DOS

IR

Vibrations