Geometry & MOs

Info

ID:	330694
PubChem CID:	127248101
Reduced:	O2N4C19H28 (1)
Stoich.:	A2B4C19D28 (1)
Weight, g/mol:	318.169191
ΔH_f, kcal/mol:	-70.26
Dipole, Da:	6.71
IP(EA), eV:	-9.18(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[[3-(morpholine-4-carbonyl)pyrazin-2-yl]methyl]pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC(=O)N1CCC(C1)CC2=NC=CN=C2C(=O)N(C)C3CCCCC3

DOS

IR

Vibrations