Geometry & MOs

Info

ID:	344481
PubChem CID:	127268065
Reduced:	O2N5C18H27 (1)
Stoich.:	A2B5C18D27 (1)
Weight, g/mol:	331.200825
ΔH_f, kcal/mol:	-60.26
Dipole, Da:	5.32
IP(EA), eV:	-9.17(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(pyrazine-2-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)NC(=O)CN2CCN(CC2)C(=O)C3=NC=CN=C3

DOS

IR

Vibrations