Geometry & MOs

Info

ID:	198383
PubChem CID:	79093097
Reduced:	ClN3C11H18 (1)
Stoich.:	AB3C11D18 (1)
Weight, g/mol:	266.210661
ΔH_f, kcal/mol:	16.76
Dipole, Da:	1.92
IP(EA), eV:	-8.95(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethylpyrazol-4-yl)-(4-methylmorpholin-2-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CNC(CC1=C(C=NC=C1)Cl)CN(C)C

DOS

IR

Vibrations