Geometry & MOs

Info

ID:	126706
PubChem CID:	50974042
Reduced:	N5H13C16 (1)
Stoich.:	A5B13C16 (1)
Weight, g/mol:	316.201159
ΔH_f, kcal/mol:	132.73
Dipole, Da:	4.48
IP(EA), eV:	-9.52(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(1-pyrazin-2-ylpropan-2-ylamino)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2C(=NC(=N2)C)C3=CN=C(C=C3)C#N

DOS

IR

Vibrations