Geometry & MOs

Info

ID:	156640
PubChem CID:	56371478
Reduced:	O2N3C23H29 (1)
Stoich.:	A2B3C23D29 (1)
Weight, g/mol:	419.257277
ΔH_f, kcal/mol:	-73.84
Dipole, Da:	3.15
IP(EA), eV:	-7.94(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-pyrrolidin-1-ylphenyl)-3-[[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]amino]butanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)NC(C)CC(=O)NC2=CC(=CC=C2)N3CCCC3

DOS

IR

Vibrations