Geometry & MOs

Info

ID:	57673
PubChem CID:	22432088
Reduced:	O3N5C15H17 (1)
Stoich.:	A3B5C15D17 (1)
Weight, g/mol:	332.196074
ΔH_f, kcal/mol:	-39.89
Dipole, Da:	5.85
IP(EA), eV:	-9.54(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-morpholin-4-ylethylamino)-3-(5-phenyltetrazol-1-yl)propan-2-ol

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)CCCNC(=O)C2=NN=C(O2)C3=CN=CC=C3

DOS

IR

Vibrations