Geometry & MOs

Info

ID:	25835
PubChem CID:	631525
Reduced:	ON2C10H10 (2)
Stoich.:	AB2C10D10 (2)
Weight, g/mol:	348.131029
ΔH_f, kcal/mol:	34.0
Dipole, Da:	5.2
IP(EA), eV:	-8.31(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N-methyl-6-N-[[4-(trifluoromethyl)phenyl]methyl]pyrido[3,2-d]pyrimidine-2,4,6-triamine

Drug info:

PubChemData

Smile

CC1=NN(C(=O)C1=NC2=CC=C(C=C2)N3CCOCC3)C4=CC=CC=C4

DOS

IR

Vibrations