Geometry & MOs

Info

ID:	194503
PubChem CID:	78546527
Reduced:	NO3C24H29 (1)
Stoich.:	AB3C24D29 (1)
Weight, g/mol:	413.199094
ΔH_f, kcal/mol:	-110.37
Dipole, Da:	3.0
IP(EA), eV:	-9.0(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-oxo-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propan-2-yl] 2-benzylbenzoate

Drug info:

PubChemData

Smile

CC1CCCC(N1C(=O)C(C)OC(=O)C2=CC=CC=C2CC3=CC=CC=C3)C

DOS

IR

Vibrations