Geometry & MOs

Info

ID:	363278
PubChem CID:	127310433
Reduced:	O2N4C23H24 (1)
Stoich.:	A2B4C23D24 (1)
Weight, g/mol:	352.110232
ΔH_f, kcal/mol:	0.45
Dipole, Da:	5.06
IP(EA), eV:	-8.47(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-2-fluorophenyl)-2-[(4-methylpyrazol-1-yl)methyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)NC3=CC4=C(C=C3)C5=CC=CC=C5C4

DOS

IR

Vibrations