Geometry & MOs

Info

ID:	190644
PubChem CID:	78036067
Reduced:	O2N3C20H29 (1)
Stoich.:	A2B3C20D29 (1)
Weight, g/mol:	341.210327
ΔH_f, kcal/mol:	-76.21
Dipole, Da:	3.12
IP(EA), eV:	-8.96(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

amino 2-[3-(1-phenylethyl)-2-propan-2-yl-4,5,6,7-tetrahydrobenzimidazol-4-yl]acetate

Drug info:

PubChemData

Smile

CC(C)C1=NC2=C(N1C(C)C3=CC=CC=C3)C(CCC2)CC(=O)O.N

DOS

IR

Vibrations