Geometry & MOs

Info

ID:	187516
PubChem CID:	77583442
Reduced:	O4C27H32 (1)
Stoich.:	A4B27C32 (1)
Weight, g/mol:	292.178693
ΔH_f, kcal/mol:	-151.14
Dipole, Da:	2.75
IP(EA), eV:	-8.98(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[(1,2-dimethylpyrrolidin-2-yl)-hydroxymethyl]phenyl]ethylcarbamic acid

Drug info:

PubChemData

Smile

CCOC(=O)C=CC1=CC=C(C=C1)C(=C2CC(OC(C2)(C)C)(C)C)C3=CC=C(C=C3)O

DOS

IR

Vibrations