Geometry & MOs

Info

ID:	266230
PubChem CID:	103559849
Reduced:	ClON3C14H24 (1)
Stoich.:	ABC3D14E24 (1)
Weight, g/mol:	224.152478
ΔH_f, kcal/mol:	-27.84
Dipole, Da:	2.4
IP(EA), eV:	-8.88(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methoxycyclobutyl)-3-(1-methylpyrazol-3-yl)propan-2-ol

Drug info:

PubChemData

Smile

CC(C)N1C(=C(C=N1)Cl)C(CC2(CCC2)OC)NC

DOS

IR

Vibrations