Geometry & MOs

Info

ID:	35516
PubChem CID:	7979978
Reduced:	SN3O5C18H19 (1)
Stoich.:	AB3C5D18E19 (1)
Weight, g/mol:	399.125277
ΔH_f, kcal/mol:	-107.62
Dipole, Da:	4.95
IP(EA), eV:	-9.5(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(E)-3-phenylprop-2-enoyl]-4-pyrrolidin-1-ylsulfonylbenzohydrazide

Drug info:

PubChemData

Smile

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)/C=C/C3=CC=CO3

DOS

IR

Vibrations