Geometry & MOs

Info

ID:	126297
PubChem CID:	50959058
Reduced:	O2N5C19H21 (1)
Stoich.:	A2B5C19D21 (1)
Weight, g/mol:	380.115237
ΔH_f, kcal/mol:	21.13
Dipole, Da:	7.16
IP(EA), eV:	-9.44(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-[5-phenyl-3-[3-(2H-tetrazol-5-yl)propyl]imidazol-4-yl]phenol

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)N2C=CC=N2)CN3CCN4C(=CC(=N4)C(=O)O)C3)C

DOS

IR

Vibrations