Geometry & MOs

Info

ID:	444375
PubChem CID:	135262216
Reduced:	H5C6F7 (1)
Stoich.:	A5B6C7 (1)
Weight, g/mol:	373.165108
ΔH_f, kcal/mol:	-343.19
Dipole, Da:	1.75
IP(EA), eV:	-11.92(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-2-(6-methylpyridin-2-yl)-4-(pyridin-4-ylamino)pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide

Drug info:

PubChemData

Smile

C(C(=C(C(F)F)C(F)F)C(F)F)F

DOS

IR

Vibrations