Geometry & MOs

Info

ID:	258092
PubChem CID:	103150834
Reduced:	OF2N3C14H21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	303.155847
ΔH_f, kcal/mol:	-128.85
Dipole, Da:	6.53
IP(EA), eV:	-9.27(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-methyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]-5,6,7,8-tetrahydroquinazolin-6-yl]methanamine

Drug info:

PubChemData

Smile

CNCC1CCC2=NC(=NC=C2C1)CCOCC(F)F

DOS

IR

Vibrations