Geometry & MOs

Info

ID:	133559
PubChem CID:	51549501
Reduced:	SN3O4C25H27 (1)
Stoich.:	AB3C4D25E27 (1)
Weight, g/mol:	195.095595
ΔH_f, kcal/mol:	-108.99
Dipole, Da:	2.12
IP(EA), eV:	-8.88(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[amino-[(3,4-dimethylphenyl)methylsulfanyl]methylidene]azanium

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC2=CC=CC=C21)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C(=O)C

DOS

IR

Vibrations