Geometry & MOs

Info

ID:	129547
PubChem CID:	51073052
Reduced:	ON2C14H26 (1)
Stoich.:	AB2C14D26 (1)
Weight, g/mol:	240.220164
ΔH_f, kcal/mol:	-55.97
Dipole, Da:	5.28
IP(EA), eV:	-8.86(1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(azepan-1-yl)propyl]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC1CC1C(=O)NCCCN2CCCCCC2

DOS

IR

Vibrations