Geometry & MOs

Info

ID:	38685
PubChem CID:	8137461
Reduced:	N3O3C17H21 (1)
Stoich.:	A3B3C17D21 (1)
Weight, g/mol:	300.067698
ΔH_f, kcal/mol:	-82.11
Dipole, Da:	1.54
IP(EA), eV:	-9.54(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(2-chloro-4-fluorophenoxy)acetyl]amino]-N-cyclopropylacetamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NCC(=O)NC1CC1)NC(=O)/C=C/C2=CC=CC=C2

DOS

IR

Vibrations