Geometry & MOs

Info

ID:	202547
PubChem CID:	79684731
Reduced:	IOSN3C9H10 (1)
Stoich.:	ABCD3E9F10 (1)
Weight, g/mol:	377.89783
ΔH_f, kcal/mol:	62.88
Dipole, Da:	2.03
IP(EA), eV:	-9.54(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chloro-4-methoxyphenyl)-(5-iodothiophen-3-yl)methanone

Drug info:

PubChemData

Smile

CC(CC1=NOC(=N1)C2=CSC(=C2)I)N

DOS

IR

Vibrations