Geometry & MOs

Info

ID:	358442
PubChem CID:	127296010
Reduced:	ON6C15H26 (1)
Stoich.:	AB6C15D26 (1)
Weight, g/mol:	253.215413
ΔH_f, kcal/mol:	-18.1
Dipole, Da:	5.72
IP(EA), eV:	-9.03(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-propan-2-yl-3-pyrrolidin-1-ylazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C1=NN=CN1C)NC(=O)N2CCC(C2)N3CCCCC3

DOS

IR

Vibrations