Geometry & MOs

Info

ID:	126173
PubChem CID:	50954379
Reduced:	N3O5C20H23 (1)
Stoich.:	A3B5C20D23 (1)
Weight, g/mol:	303.231063
ΔH_f, kcal/mol:	-157.06
Dipole, Da:	3.57
IP(EA), eV:	-9.31(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4,5-dimethyl-1H-benzimidazol-2-yl)ethyl]-4-methoxy-4-methylpentan-2-amine

Drug info:

PubChemData

Smile

CCOCCN1C2=C(C=C(C=N2)C(=O)O)N(C1=O)CC[C@@H](C3=CC=CC=C3)O

DOS

IR

Vibrations