Geometry & MOs

Info

ID:	137645
PubChem CID:	52239803
Reduced:	N2O5C22H32 (1)
Stoich.:	A2B5C22D32 (1)
Weight, g/mol:	401.196408
ΔH_f, kcal/mol:	-216.02
Dipole, Da:	5.58
IP(EA), eV:	-9.01(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclohexylbenzimidazol-2-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)N1CCO[C@@H]2[C@@H]1CCCC2)NC(=O)C3=CC(=CC(=C3)OC)OC

DOS

IR

Vibrations