Geometry & MOs

Info

ID:	126428
PubChem CID:	50964614
Reduced:	ClN2O3C17H25 (1)
Stoich.:	AB2C3D17E25 (1)
Weight, g/mol:	330.149204
ΔH_f, kcal/mol:	-129.07
Dipole, Da:	3.01
IP(EA), eV:	-9.06(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(4-fluorophenyl)oxolan-3-yl]methylamino]-N-pyrazin-2-ylacetamide

Drug info:

PubChemData

Smile

CCC(CNC(=O)C1(CCNCC1)OC2=CC=C(C=C2)Cl)OC

DOS

IR

Vibrations