Geometry & MOs

Info

ID:	168911
PubChem CID:	75040869
Reduced:	NOC12H21 (1)
Stoich.:	ABC12D21 (1)
Weight, g/mol:	374.168916
ΔH_f, kcal/mol:	-23.73
Dipole, Da:	3.33
IP(EA), eV:	-8.21(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[4-(carbamoylamino)-6-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxol-4-yl]acetate

Drug info:

PubChemData

Smile

CC(=CC(=[N+](C1CCCCC1)[O-])C)C

DOS

IR

Vibrations