Geometry & MOs

Info

ID:	277265
PubChem CID:	103827556
Reduced:	SN2O3C13H26 (1)
Stoich.:	AB2C3D13E26 (1)
Weight, g/mol:	261.184112
ΔH_f, kcal/mol:	-167.97
Dipole, Da:	7.16
IP(EA), eV:	-9.66(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopropylmethoxy)ethyl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1CCCC(C1)CNC(=O)C(CCS(=O)(=O)C)N

DOS

IR

Vibrations