Geometry & MOs

Info

ID:	336520
PubChem CID:	127255527
Reduced:	N2S3H26C32 (1)
Stoich.:	A2B3C26D32 (1)
Weight, g/mol:	296.92259
ΔH_f, kcal/mol:	225.79
Dipole, Da:	2.93
IP(EA), eV:	-7.93(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(bromomethyl)-2-chlorophenyl]methanesulfonamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C#CC2=CC=C(S2)C3=CC=C(S3)C4=CC=C(S4)C#CC5=CC=C(C=C5)N(C)C

DOS

IR

Vibrations