Geometry & MOs

Info

ID:	247646
PubChem CID:	103072548
Reduced:	IN3C9H14 (1)
Stoich.:	AB3C9D14 (1)
Weight, g/mol:	277.00759
ΔH_f, kcal/mol:	65.22
Dipole, Da:	4.07
IP(EA), eV:	-9.15(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-iodopyrazol-1-yl)methyl]-N-methylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CCNCC(=C)CN1C=C(C=N1)I

DOS

IR

Vibrations