Geometry & MOs

Info

ID:	263830
PubChem CID:	103401016
Reduced:	ClNOSF2H12C13 (1)
Stoich.:	ABCDE2F12G13 (1)
Weight, g/mol:	334.92048
ΔH_f, kcal/mol:	-100.63
Dipole, Da:	4.09
IP(EA), eV:	-8.86(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromothiophen-2-yl)-1-(3-chloro-4-methylthiophen-2-yl)-N-methylmethanamine

Drug info:

PubChemData

Smile

CC1=CSC(=C1Cl)C(C2=C(C=C(C=C2F)OC)F)N

DOS

IR

Vibrations