Geometry & MOs

Info

ID:	441875
PubChem CID:	135246307
Reduced:	FN4C21H23 (1)
Stoich.:	AB4C21D23 (1)
Weight, g/mol:	136.100048
ΔH_f, kcal/mol:	99.63
Dipole, Da:	2.86
IP(EA), eV:	-8.75(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,5-trimethyl-4-methylidenepyrimidine

Drug info:

PubChemData

Smile

CCC(=NC(=C)C1=CC=CC=C1)C2=C(N(N2C)NC3=CC=CC=C3F)C

DOS

IR

Vibrations