Geometry & MOs

Info

ID:	330028
PubChem CID:	127247015
Reduced:	O2N6C17H24 (1)
Stoich.:	A2B6C17D24 (1)
Weight, g/mol:	340.201159
ΔH_f, kcal/mol:	-17.67
Dipole, Da:	4.23
IP(EA), eV:	-8.91(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-cyclopropyl-2-ethylpyrazol-3-yl)-[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)C1=NN=C(O1)CCC(=O)N2CCCC2C3=CN=CC(=N3)NC

DOS

IR

Vibrations