Geometry & MOs

Info

ID:	214026
PubChem CID:	81065834
Reduced:	N2O4C15H24 (1)
Stoich.:	A2B4C15D24 (1)
Weight, g/mol:	265.088498
ΔH_f, kcal/mol:	-179.17
Dipole, Da:	5.04
IP(EA), eV:	-9.01(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(thieno[3,2-d]pyrimidin-4-ylamino)methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)NC(C)CCC1=CC=CO1

DOS

IR

Vibrations