Geometry & MOs

Info

ID:	444531
PubChem CID:	135262749
Reduced:	ON2C9H12 (3)
Stoich.:	AB2C9D12 (3)
Weight, g/mol:	285.103479
ΔH_f, kcal/mol:	-39.96
Dipole, Da:	4.83
IP(EA), eV:	-8.73(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-4-methyl-N-[(2-methyloxiran-2-yl)methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C3CCN(CC3)C4CCOC4)N(N=C2)C5=CC(=NC(=N5)OC)N6CC(C6)C(C)O

DOS

IR

Vibrations