Geometry & MOs

Info

ID:	189033
PubChem CID:	77806450
Reduced:	N2O5C23H38 (1)
Stoich.:	A2B5C23D38 (1)
Weight, g/mol:	442.262028
ΔH_f, kcal/mol:	-250.8
Dipole, Da:	4.05
IP(EA), eV:	-9.56(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-hydroxy-4-[7-(methylamino)-5,6,7,8-tetrahydronaphthalen-2-yl]butyl]-4-(2-methylphenyl)benzamide

Drug info:

PubChemData

Smile

CC1(C2C1C(N(C2)C(=O)C(CCCCC=C)NC(=O)OC(C)(C)C)CC(=O)OC)C

DOS

IR

Vibrations