Geometry & MOs

Info

ID:	142426
PubChem CID:	53032511
Reduced:	OSN2C18H18 (1)
Stoich.:	ABC2D18E18 (1)
Weight, g/mol:	316.132411
ΔH_f, kcal/mol:	24.82
Dipole, Da:	6.06
IP(EA), eV:	-8.24(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methylphenyl)methyl]-3-phenyl-[1,2]oxazolo[4,5-d]pyrimidin-7-amine

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)CN2C3=CC=CC=C3C=C2C4=CC=CS4

DOS

IR

Vibrations