Geometry & MOs

Info

ID:	432298
PubChem CID:	135172431
Reduced:	N3O5C17H17 (1)
Stoich.:	A3B5C17D17 (1)
Weight, g/mol:	408.06986
ΔH_f, kcal/mol:	-147.91
Dipole, Da:	3.99
IP(EA), eV:	-10.24(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R,3S)-3-(methylamino)-2,3-diphenylbutan-2-yl]carbamoyl iodide

Drug info:

PubChemData

Smile

CN(C1C(C(=O)NC(=O)NC1=O)CC=C)C(=O)C2=CC=CC=C2C=O

DOS

IR

Vibrations