Geometry & MOs

Info

ID:	432195
PubChem CID:	135172327
Reduced:	NOC13H23 (1)
Stoich.:	ABC13D23 (1)
Weight, g/mol:	407.243359
ΔH_f, kcal/mol:	-39.42
Dipole, Da:	2.2
IP(EA), eV:	-8.53(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-ethoxypyridin-3-yl)-2-N-methyl-3-(2-methylpropanimidoyl)-4-N-[(1-methylpyrazol-3-yl)methyl]pyridine-2,4-diamine

Drug info:

PubChemData

Smile

CCC(CC(=C=O)C)C(=C)NCC(C)C

DOS

IR

Vibrations