Geometry & MOs

Info

ID:	137931
PubChem CID:	52285595
Reduced:	SN3O3C22H23 (1)
Stoich.:	AB3C3D22E23 (1)
Weight, g/mol:	360.077777
ΔH_f, kcal/mol:	-56.07
Dipole, Da:	5.64
IP(EA), eV:	-8.48(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-N'-[4-(difluoromethylsulfonyl)phenyl]-N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine

Drug info:

PubChemData

Smile

C1C[C@H](OC1)CN(CC2=CC=CC=C2O)C(=O)NC3=CC=C(C=C3)C4=NC=CS4

DOS

IR

Vibrations