Geometry & MOs

Info

ID:	217274
PubChem CID:	85087542
Reduced:	O3C23H24 (1)
Stoich.:	A3B23C24 (1)
Weight, g/mol:	348.204907
ΔH_f, kcal/mol:	-70.38
Dipole, Da:	1.56
IP(EA), eV:	-8.63(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[4-methyl-1-[(3-methyl-1-oxobutan-2-yl)amino]-1-oxopentan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1CC2=C(C3=CC=CC=C3C(=C2C(O1)C)OC)OCC4=CC=CC=C4

DOS

IR

Vibrations