Geometry & MOs

Info

ID:	266105
PubChem CID:	103558411
Reduced:	N3O3C8H15 (1)
Stoich.:	A3B3C8D15 (1)
Weight, g/mol:	182.094294
ΔH_f, kcal/mol:	-113.89
Dipole, Da:	2.9
IP(EA), eV:	-9.7(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(1-methoxycyclobutyl)but-2-ynoate

Drug info:

PubChemData

Smile

COC1(CCC1)CC(=O)NNC(=O)N

DOS

IR

Vibrations