Geometry & MOs

Info

ID:	75026
PubChem CID:	48422874
Reduced:	SN2O6C19H28 (1)
Stoich.:	AB2C6D19E28 (1)
Weight, g/mol:	397.200156
ΔH_f, kcal/mol:	-219.11
Dipole, Da:	8.18
IP(EA), eV:	-8.89(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[2-(4-tert-butylbenzoyl)hydrazinyl]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)NC(=O)C(C)OCC2CC2)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations