Geometry & MOs

Info

ID:	217452
PubChem CID:	85087847
Reduced:	N3O3C21H23 (1)
Stoich.:	A3B3C21D23 (1)
Weight, g/mol:	365.231456
ΔH_f, kcal/mol:	-16.0
Dipole, Da:	0.99
IP(EA), eV:	-9.12(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-hydroxy-6-[(2-methylphenyl)carbamoylamino]hexan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCOC(=O)C(=C(C1=CC=CC=C1)NO)C(=NN=C(C)C2=CC=CC=C2)C

DOS

IR

Vibrations