Geometry & MOs

Info

ID:	289976
PubChem CID:	104393477
Reduced:	O2N3C10H21 (1)
Stoich.:	A2B3C10D21 (1)
Weight, g/mol:	253.179027
ΔH_f, kcal/mol:	-122.65
Dipole, Da:	1.75
IP(EA), eV:	-9.39(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclopropylamino)-1-oxopropan-2-yl]azepane-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)C(C)NC(=O)CCCN

DOS

IR

Vibrations