Geometry & MOs

Info

ID:	349296
PubChem CID:	127275083
Reduced:	N3O3C20H29 (1)
Stoich.:	A3B3C20D29 (1)
Weight, g/mol:	297.205242
ΔH_f, kcal/mol:	-121.66
Dipole, Da:	5.64
IP(EA), eV:	-9.04(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(2-methyl-1,4-oxazepan-4-yl)acetyl]piperidin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)CC(=O)N2CCC(CC2)NC(=O)C3=CC=CC=C3

DOS

IR

Vibrations