Geometry & MOs

Info

ID:	206737
PubChem CID:	80292446
Reduced:	BrOSN4H11C12 (1)
Stoich.:	ABCD4E11F12 (1)
Weight, g/mol:	209.098669
ΔH_f, kcal/mol:	30.09
Dipole, Da:	3.02
IP(EA), eV:	-9.02(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohexylimidazole-2-carbothioamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)NC(=O)CN2C=CN=C2C(=S)N)Br

DOS

IR

Vibrations