Geometry & MOs

Info

ID:	209202
PubChem CID:	80637957
Reduced:	OCl2N2C16H18 (1)
Stoich.:	AB2C2D16E18 (1)
Weight, g/mol:	172.10342
ΔH_f, kcal/mol:	-13.68
Dipole, Da:	3.63
IP(EA), eV:	-9.04(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-ethylthiane-2-carboximidamide

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1OC2=C(C=C(C=C2)Cl)Cl)CNC(C)C

DOS

IR

Vibrations