Geometry & MOs

Info

ID:	176985
PubChem CID:	76122168
Reduced:	NSO4C11H15 (1)
Stoich.:	ABC4D11E15 (1)
Weight, g/mol:	572.336256
ΔH_f, kcal/mol:	-134.77
Dipole, Da:	6.11
IP(EA), eV:	-9.62(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9H-fluoren-9-ylmethyl N-[1-[(5-hydroxy-2-methyl-7-propan-2-ylnon-8-en-4-yl)amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(C)C(CO)C=O

DOS

IR

Vibrations