Geometry & MOs

Info

ID:	279774
PubChem CID:	103845130
Reduced:	ClFNOC14H21 (1)
Stoich.:	ABCDE14F21 (1)
Weight, g/mol:	324.252526
ΔH_f, kcal/mol:	-104.52
Dipole, Da:	1.42
IP(EA), eV:	-9.36(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[[(2-ethylpyrazol-3-yl)methylamino]methyl]pentan-3-yl]carbamate

Drug info:

PubChemData

Smile

CCCC(CCO)CNCC1=C(C=CC(=C1)Cl)F

DOS

IR

Vibrations