Geometry & MOs

Info

ID:	286661
PubChem CID:	104179621
Reduced:	FNC15H20 (1)
Stoich.:	ABC15D20 (1)
Weight, g/mol:	243.140533
ΔH_f, kcal/mol:	-19.88
Dipole, Da:	2.64
IP(EA), eV:	-9.0(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethylsulfanylpropyl)-1-(2-methoxyethyl)pyrazol-3-amine

Drug info:

PubChemData

Smile

C/C=C/CCNC1CC(C1)C2=CC(=CC=C2)F

DOS

IR

Vibrations