Geometry & MOs

Info

ID:	154930
PubChem CID:	56314480
Reduced:	BrN3O4C17H20 (1)
Stoich.:	AB3C4D17E20 (1)
Weight, g/mol:	484.182121
ΔH_f, kcal/mol:	-85.42
Dipole, Da:	2.67
IP(EA), eV:	-9.37(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-N'-[3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]propanoyl]-4-propan-2-yloxybenzohydrazide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C(C)C(=O)NNC(=O)C(C)OC2=CC(=CC=C2)Br

DOS

IR

Vibrations