Geometry & MOs

Info

ID:	251403
PubChem CID:	103103734
Reduced:	O3N4C13H26 (1)
Stoich.:	A3B4C13D26 (1)
Weight, g/mol:	225.122575
ΔH_f, kcal/mol:	-121.46
Dipole, Da:	3.13
IP(EA), eV:	-9.47(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-N-(2-amino-2-oxoethyl)-N-ethyl-1-methylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCCC(CCC)(C(=NO)N)C(=O)N(CC)CC(=O)N

DOS

IR

Vibrations