Geometry & MOs

Info

ID:	274999
PubChem CID:	103813066
Reduced:	ON3C17H27 (1)
Stoich.:	AB3C17D27 (1)
Weight, g/mol:	238.204513
ΔH_f, kcal/mol:	-26.43
Dipole, Da:	2.12
IP(EA), eV:	-9.05(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[(1-propylcyclopropyl)methyl]cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CCCC1(CC1)CNC(=O)C2=CC=CN2C3CCNCC3

DOS

IR

Vibrations