Geometry & MOs

Info

ID:	280419
PubChem CID:	103849179
Reduced:	NO2C6H8 (2)
Stoich.:	AB2C6D8 (2)
Weight, g/mol:	189.100108
ΔH_f, kcal/mol:	-165.99
Dipole, Da:	8.53
IP(EA), eV:	-9.48(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[(3-hydroxyoxolan-3-yl)methyl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=O)C(=CN1)C(=O)NCC2(CCOC2)O

DOS

IR

Vibrations