Geometry & MOs

Info

ID:	208883
PubChem CID:	80599280
Reduced:	ON2C16H24 (1)
Stoich.:	AB2C16D24 (1)
Weight, g/mol:	194.105528
ΔH_f, kcal/mol:	-39.43
Dipole, Da:	4.74
IP(EA), eV:	-8.44(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methylmorpholine-4-carbonyl)cyclopropane-1-carbonitrile

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=CC=C1NC(=O)C2(CCC2)CN

DOS

IR

Vibrations