Geometry & MOs

Info

ID:	387865
PubChem CID:	134987194
Reduced:	ON4C11H12 (1)
Stoich.:	AB4C11D12 (1)
Weight, g/mol:	198.067224
ΔH_f, kcal/mol:	18.29
Dipole, Da:	4.16
IP(EA), eV:	-8.88(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-4-methyl-6-pyrrolidin-1-yltriazine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=N1)N=C(N(C2=O)CC=C)N

DOS

IR

Vibrations