Geometry & MOs

Info

ID:	205613
PubChem CID:	80127371
Reduced:	OSN2C11H16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	304.080097
ΔH_f, kcal/mol:	-0.29
Dipole, Da:	2.72
IP(EA), eV:	-8.89(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-[(3,5-dimethylphenyl)methylsulfanyl]benzenecarboximidamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)CSCC(=NO)N)C

DOS

IR

Vibrations