Geometry & MOs

Info

ID:	132793
PubChem CID:	51421915
Reduced:	OSN2C14H23 (1)
Stoich.:	ABC2D14E23 (1)
Weight, g/mol:	369.145973
ΔH_f, kcal/mol:	-35.49
Dipole, Da:	5.42
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.767232
Charge, e:	1

Chem-info

IUPAC name:

di(propan-2-yl)-[2-[[4-(trifluoromethoxy)phenyl]sulfonylamino]ethyl]azanium

Drug info:

PubChemData

Smile

CC(C)[N+](=C(N)SC1=CC=C(C=C1)OC)C(C)C

DOS

IR

Vibrations