Geometry & MOs

Info

ID:	407264
PubChem CID:	135079692
Reduced:	ClNO3H20C23 (1)
Stoich.:	ABC3D20E23 (1)
Weight, g/mol:	263.098
ΔH_f, kcal/mol:	-5.95
Dipole, Da:	3.77
IP(EA), eV:	-8.94(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-pent-2-enyl]-N-prop-2-ynylbenzenesulfonamide

Drug info:

PubChemData

Smile

C1CCC(=CC1)N(CC2=CC=CC=C2)C(=O)C#CC3=C(C=CC4=C3OCO4)Cl

DOS

IR

Vibrations