Geometry & MOs

Info

ID:	84375
PubChem CID:	49866091
Reduced:	BrSN2C11H17 (1)
Stoich.:	ABC2D11E17 (1)
Weight, g/mol:	302.04523
ΔH_f, kcal/mol:	3.77
Dipole, Da:	1.31
IP(EA), eV:	-9.07(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-tert-butylphenyl)methyl carbamimidothioate;hydrobromide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)CSC(=N)N.Br

DOS

IR

Vibrations