Geometry & MOs

Info

ID:	126734
PubChem CID:	50975579
Reduced:	N5C18H21 (1)
Stoich.:	A5B18C21 (1)
Weight, g/mol:	320.149793
ΔH_f, kcal/mol:	81.12
Dipole, Da:	2.71
IP(EA), eV:	-9.15(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-[5-(1H-imidazol-2-yl)-4-phenylimidazol-1-yl]propyl]-2H-tetrazole

Drug info:

PubChemData

Smile

CC1=C(C=CN=C1)CN(C)C2=NC(=NC3=CC=CC=C32)CCN

DOS

IR

Vibrations