Geometry & MOs

Info

ID:	258039
PubChem CID:	103150224
Reduced:	N2O2F3C14H17 (1)
Stoich.:	A2B2C3D14E17 (1)
Weight, g/mol:	275.124547
ΔH_f, kcal/mol:	-231.68
Dipole, Da:	6.09
IP(EA), eV:	-10.39(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2,2,2-trifluoroethoxy)ethyl]-5,6,7,8-tetrahydroquinazolin-5-amine

Drug info:

PubChemData

Smile

CC1(CC2=NC(=NC=C2C(=O)C1)CCOCC(F)(F)F)C

DOS

IR

Vibrations