Geometry & MOs

Info

ID:	404081
PubChem CID:	135064940
Reduced:	NO4C17H25 (1)
Stoich.:	AB4C17D25 (1)
Weight, g/mol:	305.199094
ΔH_f, kcal/mol:	-171.62
Dipole, Da:	3.08
IP(EA), eV:	-9.46(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(3R,4R)-4-formyl-1-phenylhexan-3-yl]carbamate

Drug info:

PubChemData

Smile

C[C@@H](C=O)[C@@H](COCC1=CC=CC=C1)NC(=O)OC(C)(C)C

DOS

IR

Vibrations