Geometry & MOs

Info

ID:	190690
PubChem CID:	78042450
Reduced:	PN4O7C13H19 (1)
Stoich.:	AB4C7D13E19 (1)
Weight, g/mol:	334.179361
ΔH_f, kcal/mol:	-327.38
Dipole, Da:	6.16
IP(EA), eV:	-8.59(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(5-amino-2-bicyclo[5.1.0]oct-1(7)-enyl)imidazo[4,5-c]quinolin-2-yl]ethanol

Drug info:

PubChemData

Smile

CC(C1C(C(C(O1)N2C=CC3=C(N=CN=C32)N)(C)O)O)OP(=O)(O)O

DOS

IR

Vibrations