Geometry & MOs

Info

ID:	380755
PubChem CID:	134971294
Reduced:	OPN2C16H33 (1)
Stoich.:	ABC2D16E33 (1)
Weight, g/mol:	218.094294
ΔH_f, kcal/mol:	-137.54
Dipole, Da:	4.51
IP(EA), eV:	-8.83(1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1R,2S)-1-acetyl-2-phenylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)CN1[C@@H]2CCCCC2N(P1=O)CC(C)(C)C

DOS

IR

Vibrations