Geometry & MOs

Info

ID:	420162
PubChem CID:	135111518
Reduced:	NOC11H13 (2)
Stoich.:	ABC11D13 (2)
Weight, g/mol:	358.236876
ΔH_f, kcal/mol:	-37.75
Dipole, Da:	4.23
IP(EA), eV:	-8.68(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-(4-methylphenoxy)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N3C[C@H]4CN([C@@H](C3)COC4)C

DOS

IR

Vibrations