Geometry & MOs

Info

ID:	231601
PubChem CID:	87574290
Reduced:	SN5C15H17 (1)
Stoich.:	AB5C15D17 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	111.49
Dipole, Da:	5.68
IP(EA), eV:	-8.46(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(2-methylpropan-2-yl)oxy]-3-oxo-1-phenylpropyl]formamide

Drug info:

PubChemData

Smile

CCN1C(=NNC1=S)C2=CC=CN(N2)C3=CC=C(C=C3)C

DOS

IR

Vibrations