Geometry & MOs

Info

ID:	289394
PubChem CID:	104349342
Reduced:	N3O3C14H25 (1)
Stoich.:	A3B3C14D25 (1)
Weight, g/mol:	295.189592
ΔH_f, kcal/mol:	-156.35
Dipole, Da:	4.85
IP(EA), eV:	-9.21(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-(2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)pyrrolidin-3-yl]carbamate

Drug info:

PubChemData

Smile

COC(=O)NC1CCN(C1)C(=O)C2CCCCCC2N

DOS

IR

Vibrations