Geometry & MOs

Info

ID:	340226
PubChem CID:	127262235
Reduced:	SN2C22H22 (1)
Stoich.:	AB2C22D22 (1)
Weight, g/mol:	386.041125
ΔH_f, kcal/mol:	79.84
Dipole, Da:	1.3
IP(EA), eV:	-8.73(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N,N-bis(4-chlorophenyl)carbamimidothioate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N(C2=CC=CC=C2C)C(=N)SCC3=CC=CC=C3

DOS

IR

Vibrations