Geometry & MOs

Info

ID:	74529
PubChem CID:	48422021
Reduced:	NF2O3C16H21 (1)
Stoich.:	AB2C3D16E21 (1)
Weight, g/mol:	309.205242
ΔH_f, kcal/mol:	-200.42
Dipole, Da:	6.16
IP(EA), eV:	-9.3(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(cyclopropylmethoxy)propanoyl]piperazin-1-yl]-N-prop-2-enylacetamide

Drug info:

PubChemData

Smile

CC(C(=O)N(C)CC1=CC=C(C=C1)OC(F)F)OCC2CC2

DOS

IR

Vibrations