Geometry & MOs

Info

ID:	79751
PubChem CID:	49830255
Reduced:	ON4C23H28 (1)
Stoich.:	AB4C23D28 (1)
Weight, g/mol:	376.135782
ΔH_f, kcal/mol:	21.52
Dipole, Da:	4.14
IP(EA), eV:	-8.02(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-benzyl-8-methoxy-2-N-(thiophen-2-ylmethyl)quinazoline-2,4-diamine

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1N=C(N=C2NCC3=CC=CC=C3)NCC4CCCCC4

DOS

IR

Vibrations