Geometry & MOs

Info

ID:	442361
PubChem CID:	135251567
Reduced:	O5N17H31C34 (1)
Stoich.:	A5B17C31D34 (1)
Weight, g/mol:	180.081635
ΔH_f, kcal/mol:	201.36
Dipole, Da:	8.84
IP(EA), eV:	-9.2(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(5-methylpyrazin-2-yl)cyclopropyl]methylphosphane

Drug info:

PubChemData

Smile

CC\1=NN(C(=N)/C1=N/NC2=C(C=NN2C3=CC=CC=C3)C(=O)OC)C4=NC(=NC(=N4)OC)N5C(=N)/C(=N/NC6=C(C=NN6C7=CC=CC=C7)C(=O)OC)/C(=N5)C

DOS

IR

Vibrations