Geometry & MOs

Info

ID:	74521
PubChem CID:	48421997
Reduced:	N2F3O3C19H19 (1)
Stoich.:	A2B3C3D19E19 (1)
Weight, g/mol:	269.173942
ΔH_f, kcal/mol:	-252.24
Dipole, Da:	6.22
IP(EA), eV:	-9.81(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(cyclopropylmethoxy)propanoyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NCC2=CC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations