Geometry & MOs

Info

ID:	58632
PubChem CID:	24712352
Reduced:	N3O3C16H19 (1)
Stoich.:	A3B3C16D19 (1)
Weight, g/mol:	338.195405
ΔH_f, kcal/mol:	-83.95
Dipole, Da:	4.48
IP(EA), eV:	-9.14(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methoxypropyl)-N-[3-(3-methoxypropylamino)-3-oxopropyl]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CN1C2=C(C(NC1=O)C3=CC=CC=C3)C(=O)N(C2)CCOC

DOS

IR

Vibrations