Geometry & MOs

Info

ID:	244079
PubChem CID:	99313626
Reduced:	N4O5C20H22 (1)
Stoich.:	A4B5C20D22 (1)
Weight, g/mol:	386.139033
ΔH_f, kcal/mol:	-172.1
Dipole, Da:	6.28
IP(EA), eV:	-9.0(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-4-[[2-[[2-(3-fluorophenyl)acetyl]amino]acetyl]amino]benzamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C(=O)NCC(=O)NC2=CC=C(C=C2)C(=O)NCC(=O)N

DOS

IR

Vibrations