Geometry & MOs

Info

ID:	388945
PubChem CID:	134990701
Reduced:	ClN2O4C26H35 (1)
Stoich.:	AB2C4D26E35 (1)
Weight, g/mol:	255.138992
ΔH_f, kcal/mol:	-190.37
Dipole, Da:	6.35
IP(EA), eV:	-9.28(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[4-(2-methylpropyl)phenyl]propanimidate;hydrochloride

Drug info:

PubChemData

Smile

CCOC(=O)C(CCC1=CC=CC=C1)N[C@@H](C)CN(CC(=O)O)C2CC3=CC=CC=C3C2.Cl

DOS

IR

Vibrations