Geometry & MOs

Info

ID:	362566
PubChem CID:	127308278
Reduced:	ClFON3C14H17 (1)
Stoich.:	ABCD3E14F17 (1)
Weight, g/mol:	399.190654
ΔH_f, kcal/mol:	-74.87
Dipole, Da:	6.36
IP(EA), eV:	-8.94(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(morpholine-4-carbonyl)phenyl]-2-(pyrazol-1-ylmethyl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC2CN(CCN2C1)C(=O)NC3=CC(=C(C=C3)Cl)F

DOS

IR

Vibrations