Geometry & MOs

Info

ID:	251282
PubChem CID:	103102715
Reduced:	ON3C10H21 (1)
Stoich.:	AB3C10D21 (1)
Weight, g/mol:	244.145474
ΔH_f, kcal/mol:	-62.64
Dipole, Da:	4.36
IP(EA), eV:	-8.67(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(4-chloro-5-ethyl-2-methylpyrazol-3-yl)methyl]-N'-ethylethane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C1CNCCC1C

DOS

IR

Vibrations