Geometry & MOs

Info

ID:	351714
PubChem CID:	127282114
Reduced:	O2N5C21H35 (1)
Stoich.:	A2B5C21D35 (1)
Weight, g/mol:	397.21139
ΔH_f, kcal/mol:	-87.4
Dipole, Da:	4.44
IP(EA), eV:	-9.05(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(4-oxopyrido[1,2-a]pyrimidine-3-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CCN1C(=CC(=N1)C(C)C)C(=O)N2CCN(CC2)C(C)C(=O)NC3CCCC3

DOS

IR

Vibrations