Geometry & MOs

Info

ID:	13898
PubChem CID:	399693
Reduced:	ClN8C25H29 (1)
Stoich.:	AB8C25D29 (1)
Weight, g/mol:	476.220371
ΔH_f, kcal/mol:	97.1
Dipole, Da:	5.46
IP(EA), eV:	-9.14(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-4,6-bis[4-(5-methyl-4,5-dihydro-1H-imidazol-2-yl)phenyl]-1,3,5-triazin-2-amine;hydrochloride

Drug info:

PubChemData

Smile

CC1CN=C(N1)C2=CC=C(C=C2)C3=NC(=NC(=N3)N(C)C)C4=CC=C(C=C4)C5=NCC(N5)C.Cl

DOS

IR

Vibrations