Geometry & MOs

Info

ID:	433648
PubChem CID:	135173788
Reduced:	SN3O3C24H27 (1)
Stoich.:	AB3C3D24E27 (1)
Weight, g/mol:	212.106196
ΔH_f, kcal/mol:	-64.72
Dipole, Da:	3.3
IP(EA), eV:	-8.46(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-ethylpyrrolo[2,3-h]quinazolin-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1C2=NC3=C(S2)CN(C3)C(=O)OC(C)(C)C)C4=C(C(=CC=C4)N)OC

DOS

IR

Vibrations