Geometry & MOs

Info

ID:	36306
PubChem CID:	8001510
Reduced:	N3O4C23H25 (1)
Stoich.:	A3B4C23D25 (1)
Weight, g/mol:	379.115462
ΔH_f, kcal/mol:	-113.02
Dipole, Da:	1.3
IP(EA), eV:	-9.14(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]thieno[2,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

C1COC2=CC=CC=C2[C@]13C(=O)N(C(=O)N3)C[C@H]4CN(CCO4)CC5=CC=CC=C5

DOS

IR

Vibrations