Geometry & MOs

Info

ID:	244234
PubChem CID:	99319526
Reduced:	FN3O3C19H26 (1)
Stoich.:	AB3C3D19E26 (1)
Weight, g/mol:	389.138699
ΔH_f, kcal/mol:	-183.08
Dipole, Da:	3.82
IP(EA), eV:	-9.55(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[2-(3-fluorophenyl)acetyl]amino]ethyl]-3-(2-nitrophenoxy)propanamide

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCC[C@H]1C(=O)NCCNC(=O)CC2=CC(=CC=C2)F

DOS

IR

Vibrations