Geometry & MOs

Info

ID:	402286
PubChem CID:	135055356
Reduced:	N2O6C23H26 (1)
Stoich.:	A2B6C23D26 (1)
Weight, g/mol:	443.205636
ΔH_f, kcal/mol:	-207.91
Dipole, Da:	5.04
IP(EA), eV:	-9.17(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-(ethoxycarbonylamino)-N-[(1R,2R)-1-phenyl-1-(phenylmethoxycarbonylamino)propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCOC(=O)[C@H](C/C(=N/C(=O)OCC1=CC=CC=C1)/C2=CC=C(C=C2)OC)NC(=O)C

DOS

IR

Vibrations