Geometry & MOs

Info

ID:	388747
PubChem CID:	134990072
Reduced:	ClN2C9H13 (1)
Stoich.:	AB2C9D13 (1)
Weight, g/mol:	192.081635
ΔH_f, kcal/mol:	3.99
Dipole, Da:	2.33
IP(EA), eV:	-9.43(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-[1,3]azaphospholo[1,2-a]pyrazine

Drug info:

PubChemData

Smile

CCC1=C(N=C(C(=N1)Cl)CC)C

DOS

IR

Vibrations