Geometry & MOs

Info

ID:	196964
PubChem CID:	78902093
Reduced:	FN2O4C20H23 (1)
Stoich.:	AB2C4D20E23 (1)
Weight, g/mol:	389.210327
ΔH_f, kcal/mol:	-164.14
Dipole, Da:	6.15
IP(EA), eV:	-9.39(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-methoxyphenyl)-1,4-diazepan-1-yl]-N-naphthalen-1-ylacetamide

Drug info:

PubChemData

Smile

COCC1=CC=C(O1)C(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)F

DOS

IR

Vibrations