Geometry & MOs

Info

ID:	358526
PubChem CID:	127296122
Reduced:	ON5C17H29 (1)
Stoich.:	AB5C17D29 (1)
Weight, g/mol:	368.257612
ΔH_f, kcal/mol:	-37.05
Dipole, Da:	5.75
IP(EA), eV:	-8.94(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(6-methyl-1H-indol-3-yl)ethyl]-3-pyrrolidin-1-ylazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=CN1CCNC(=O)N2CCCCC(C2)N3CCCC3

DOS

IR

Vibrations