Geometry & MOs

Info

ID:	349311
PubChem CID:	127275098
Reduced:	NOC5H9 (3)
Stoich.:	ABC5D9 (3)
Weight, g/mol:	297.205242
ΔH_f, kcal/mol:	-129.95
Dipole, Da:	3.61
IP(EA), eV:	-9.12(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2-methyl-1,4-oxazepan-4-yl)propanoyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(C)C(=O)N(C)CC(=O)NC2CC2

DOS

IR

Vibrations