Geometry & MOs

Info

ID:	171508
PubChem CID:	75384469
Reduced:	ON3C21H21 (1)
Stoich.:	AB3C21D21 (1)
Weight, g/mol:	315.140533
ΔH_f, kcal/mol:	32.46
Dipole, Da:	4.64
IP(EA), eV:	-8.55(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[[cyclopentyl(pyridin-2-yl)methyl]amino]methyl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N(C)C1=CC=C(C=C1)NCC2=CC(=CC=C2)C3=CN=CC=C3

DOS

IR

Vibrations