Geometry & MOs

Info

ID:	264138
PubChem CID:	103431969
Reduced:	N3C14H21 (1)
Stoich.:	A3B14C21 (1)
Weight, g/mol:	285.093583
ΔH_f, kcal/mol:	16.76
Dipole, Da:	2.8
IP(EA), eV:	-9.65(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-acetyl-4-amino-2-[(2-methylphenyl)methylamino]thiophene-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1[C@H](C)N)C2CC3CCC2C3

DOS

IR

Vibrations