Geometry & MOs

Info

ID:	31273
PubChem CID:	855514
Reduced:	O2N3C19H27 (1)
Stoich.:	A2B3C19D27 (1)
Weight, g/mol:	346.1021
ΔH_f, kcal/mol:	-81.3
Dipole, Da:	3.13
IP(EA), eV:	-9.04(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-cyclopropyl-1-N-(2,2-dimethylpropyl)benzene-1,4-disulfonamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)CN2CCN(CC2)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations