Geometry & MOs

Info

ID:	348838
PubChem CID:	127274486
Reduced:	O2N3C12H19 (1)
Stoich.:	A2B3C12D19 (1)
Weight, g/mol:	239.188529
ΔH_f, kcal/mol:	-59.62
Dipole, Da:	2.07
IP(EA), eV:	-9.34(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cycloheptyl-(2-methyl-1,4-oxazepan-4-yl)methanone

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(=O)C2=CC(=NN2C)C

DOS

IR

Vibrations