Geometry & MOs

Info

ID:	255873
PubChem CID:	103135324
Reduced:	Cl2O3C14H18 (1)
Stoich.:	A2B3C14D18 (1)
Weight, g/mol:	237.220498
ΔH_f, kcal/mol:	-132.38
Dipole, Da:	2.27
IP(EA), eV:	-8.61(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-3,4,4-trimethyl-1-(1-methylpyrazol-3-yl)pentan-1-amine

Drug info:

PubChemData

Smile

CC1CCC(O1)COC2=C(C=C(C=C2Cl)CCl)OC

DOS

IR

Vibrations