Geometry & MOs

Info

ID:	11224
PubChem CID:	112076
Reduced:	SN3O3C22H37 (1)
Stoich.:	AB3C3D22E37 (1)
Weight, g/mol:	423.255563
ΔH_f, kcal/mol:	-121.63
Dipole, Da:	7.56
IP(EA), eV:	-8.67(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexylsulfamic acid;4-(dimethylamino)-2-phenyl-2-propan-2-ylpentanenitrile

Drug info:

PubChemData

Smile

CC(C)C(CC(C)N(C)C)(C#N)C1=CC=CC=C1.C1CCC(CC1)NS(=O)(=O)O

DOS

IR

Vibrations