Geometry & MOs

Info

ID:	171828
PubChem CID:	75432147
Reduced:	BrON3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	390.14357
ΔH_f, kcal/mol:	14.87
Dipole, Da:	4.24
IP(EA), eV:	-8.66(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,5-dimethyl-N-[2-[methyl-(5-methylthiophene-2-carbonyl)amino]cyclohexyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1Br)N(CCC2)CC3=NN=C(O3)C

DOS

IR

Vibrations