Geometry & MOs

Info

ID:	198381
PubChem CID:	79092652
Reduced:	IN2C17H29 (1)
Stoich.:	AB2C17D29 (1)
Weight, g/mol:	266.247047
ΔH_f, kcal/mol:	5.23
Dipole, Da:	2.79
IP(EA), eV:	-8.61(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N',N'-diethyl-1-(1-ethylpyrazol-4-yl)-N-propylpropane-1,3-diamine

Drug info:

PubChemData

Smile

CCCNC(CCN(CC)CC)CC1=CC=C(C=C1)I

DOS

IR

Vibrations