Geometry & MOs

Info

ID:	224976
PubChem CID:	85735259
Reduced:	ON5C24H33 (2)
Stoich.:	AB5C24D33 (2)
Weight, g/mol:	214.168128
ΔH_f, kcal/mol:	60.9
Dipole, Da:	9.11
IP(EA), eV:	-8.1(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-oxopentylamino)-N-propylpropanamide

Drug info:

PubChemData

Smile

C1CN(CCNCCOCCNCCN(CCNCCOCCN1)CCCNC2=C3C=CC=CC3=NC4=CC=CC=C42)CCCNC5=C6C=CC=CC6=NC7=CC=CC=C75

DOS

IR

Vibrations