Geometry & MOs

Info

ID:	234623
PubChem CID:	92303185
Reduced:	ON5C17H17 (1)
Stoich.:	AB5C17D17 (1)
Weight, g/mol:	307.14331
ΔH_f, kcal/mol:	57.55
Dipole, Da:	4.02
IP(EA), eV:	-8.35(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-(2-ethoxyphenyl)-4,10-dihydro-[1,3,5]triazino[1,2-a]benzimidazol-2-amine

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1[C@@H]2N=C(N=C3N2C4=CC=CC=C4N3)N

DOS

IR

Vibrations