Geometry & MOs

Info

ID:	39296
PubChem CID:	8140101
Reduced:	N2O2C21H28 (1)
Stoich.:	A2B2C21D28 (1)
Weight, g/mol:	325.227989
ΔH_f, kcal/mol:	-61.2
Dipole, Da:	3.35
IP(EA), eV:	-8.53(0.14)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

dimethyl-[[2-[[[(2R)-2-phenylpentanoyl]amino]methyl]phenyl]methyl]azanium

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)OCC(=O)NCC2=CC=CC=C2CN(C)C)C

DOS

IR

Vibrations