Geometry & MOs

Info

ID:	265091
PubChem CID:	103509973
Reduced:	SN3O3C14H23 (1)
Stoich.:	AB3C3D14E23 (1)
Weight, g/mol:	295.135448
ΔH_f, kcal/mol:	-123.27
Dipole, Da:	6.37
IP(EA), eV:	-7.95(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-[(2-methoxycyclopentyl)amino]-4-propan-2-yloxythiophene-2-carbonitrile

Drug info:

PubChemData

Smile

CCNC(=O)C1=C(C(=C(S1)NC2CCCC2OC)OC)N

DOS

IR

Vibrations