Geometry & MOs

Info

ID:	178660
PubChem CID:	76364005
Reduced:	ClFON4C23H30 (1)
Stoich.:	ABCD4E23F30 (1)
Weight, g/mol:	450.224261
ΔH_f, kcal/mol:	-52.3
Dipole, Da:	8.13
IP(EA), eV:	-8.74(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(difluoromethoxy)phenyl]-2-[3-[5-(4-fluorophenyl)pyrazolidin-3-yl]propyl-methylamino]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)NC(=O)C(C)N(C)CCCC2CC(NN2)C3=CC=C(C=C3)F

DOS

IR

Vibrations